methyl 2-[[4-[(3-methylphenyl)carbonylamino]phenyl]methylsulfanyl]ethanoate

Systemtic Name: methyl 2-[[4-[(3-methylphenyl)carbonylamino]phenyl]methylsulfanyl]ethanoate Openeye Name: methyl 2-[[4-[(3-methylbenzoyl)amino]phenyl]methylsulfanyl]acetate CAS Name: 2-[[4-[[(3-methylphenyl)-oxomethyl]amino]phenyl]methylthio]acetic acid methyl ester IUPAC Name: methyl 2-[[4-[(3-methylbenzoyl)amino]phenyl]methylsulfanyl]acetate Traditional Name: 2-[[4-(m-toluoylamino)benzyl]thio]acetic acid methyl ester Formula: C18H19NO3S MolecularWeight: 329.41336

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)NC2=CC=C(C=C2)CSCC(=O)OC

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)NC2=CC=C(C=C2)CSCC(=O)OC

InChI

InChI=1S/C18H19NO3S/c1-13-4-3-5-15(10-13)18(21)19-16-8-6-14(7-9-16)11-23-12-17(20)22-2/h3-10H,11-12H2,1-2H3,(H,19,21)